SCHEMBL17547807

SCHEMBL17547807

COc1ccc(-c2[nH]c3c(C#N)cnn3c(=O)c2C(C)C)cc1C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 6/20 0.38
▸ F11 P03951 1/20 0.37
▸ TLR8 Q9NR97 5/20 0.36
▸ TLR7 Q9NYK1 5/20 0.36
▸ CTSD P07339 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ BACE2 Q9Y5Z0 1/20 0.36
▸ TLR9 Q9NR96 2/20 0.35
▸ KDM6B O15054 1/20 0.35
▸ KDM5C P41229 1/20 0.35
▸ KDM5D Q9BY66 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35
▸ KDM5B Q9UGL1 1/20 0.35
▸ PHF8 Q9UPP1 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16092398 0.92 KDM5A (0.38) KDM5AF11TLR8TLR7TLR9
SCHEMBL16092379 0.92 TLR7 (0.42) TLR8TLR7TLR9
SCHEMBL16092418 0.90 AR (0.41) KDM5AF11TLR8TLR7TLR9
SCHEMBL16092358 0.89 GRM2 (0.43) KDM5ATLR8TLR7TLR9
SCHEMBL17547826 0.89 KDM5A (0.39) KDM5AKDM6BKDM5CKDM5DKDM4C
SCHEMBL17547805 0.89 KDM5A (0.39) KDM5AKDM6BKDM5CKDM5DKDM4C
SCHEMBL16092331 0.89 KDM5A (0.42) KDM5AKDM6BKDM5CKDM5DKDM4C
SCHEMBL16092427 0.88 PIK3CA (0.36) KDM5ATLR8TLR7TLR9
SCHEMBL16092360 0.87 KDM5A (0.38) KDM5AKDM6BKDM5CKDM5DKDM4C
SCHEMBL16092525 0.87 KDM5A (0.40) KDM5ATLR8TLR7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 — — US disclosed
US-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 — — US disclosed
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-03-03 — — US disclosed
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-03-03 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10035801-B2 Pyrazolo compounds and uses thereof KDM5A, KDM5C, KDM5B KDM5A 1/4885F11 4521/4885TLR8 3005/4885
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF KDM5A, KDM5C, KDM5B KDM5A 1/4885F11 4521/4885TLR8 3005/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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